About trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane
trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane (PubChem CID 102386062) has the molecular formula C16H20OSi
and a molecular weight of 256.42 g/mol. Its IUPAC name is trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane.
Molecular Properties
| Compound Name | trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane |
| PubChem CID | 102386062 |
| Molecular Formula | C16H20OSi |
| Molecular Weight | 256.42 g/mol |
| Exact Mass | 256.13 |
| IUPAC Name | trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane |
| SMILES | C/C=C(\O[Si](C)(C)C)c1ccc2ccccc2c1 |
| InChI | InChI=1S/C16H20OSi/c1-5-16(17-18(2,3)4)15-11-10-13-8-6-7-9-14(13)12-15/h5-12H,1-4H3/b16-5- |
| InChIKey | PTMGBLRHTIFAIK-BNCCVWRVSA-N |
| XLogP | 5.05 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 256.42 |
| LogP ≤ 5 | 5.05 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane?
The IUPAC name of trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane (CID 102386062) is trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane.
What is the SMILES notation for trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane?
The canonical SMILES for trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane is C/C=C(\O[Si](C)(C)C)c1ccc2ccccc2c1.
What is the InChIKey of trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane?
The InChIKey is PTMGBLRHTIFAIK-BNCCVWRVSA-N. The full InChI is InChI=1S/C16H20OSi/c1-5-16(17-18(2,3)4)15-11-10-13-8-6-7-9-14(13)12-15/h5-12H,1-4H3/b16-5-.
What are the key properties of trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane?
trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane has a molecular weight of 256.42 g/mol, XLogP of 5.05, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-1-naphthalen-2-ylprop-1-enoxy]silane is sourced from PubChem (CID 102386062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).